4-bromanyl-2-nitro-N-prop-2-ynyl-aniline

Systemtic Name: 4-bromanyl-2-nitro-N-prop-2-ynyl-aniline Openeye Name: 4-bromo-2-nitro-N-prop-2-ynyl-aniline CAS Name: 4-bromo-2-nitro-N-prop-2-ynylaniline IUPAC Name: 4-bromo-2-nitro-N-prop-2-ynylaniline Traditional Name: (4-bromo-2-nitro-phenyl)-propargyl-amine Formula: C9H7BrN2O2 MolecularWeight: 255.06808

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC1=C(C=C(C=C1)Br)[N+](=O)[O-]

Isomeric SMILES

C#CCNC1=C(C=C(C=C1)Br)[N+](=O)[O-]

InChI

InChI=1S/C9H7BrN2O2/c1-2-5-11-8-4-3-7(10)6-9(8)12(13)14/h1,3-4,6,11H,5H2